Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-27278
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 22
  • Number of elements: 3
  • Element list: ['Mg', 'B', 'Ru']
  • Chemical System: B-Mg-Ru
  • Density: 7.90092501034231
  • Atomic Density: 0.08763928376102893
  • Unit Cell Volume: 251.02897988062824
  • Molar Volume: 6.87150841672887
  • Full Formula: Mg4 B8 Ru10
  • Reduced Formula: Mg2B4Ru5
  • Formula Anonymous: A2B4C5
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm